#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wdh s ARG 12 N 0.00 2.31 -0.11 1.97 3.52 -1.26 -5.11 118.95 120.26 2wdh s ARG 12 Ca 0.00 -0.13 -0.17 0.00 -0.13 0.00 0.00 55.73 55.31 2wdh s ARG 12 Cb 0.00 -2.14 0.04 0.00 -1.56 0.00 0.00 34.95 31.29 2wdh s ARG 12 CO 0.00 -1.20 0.43 -0.65 -0.81 0.00 0.00 175.30 173.07 2wdh s GLN 13 N -5.26 0.61 0.04 5.12 -0.21 -1.26 -5.03 119.66 113.67 2wdh s GLN 13 Ca 0.59 0.35 0.06 0.00 0.02 0.00 0.00 55.36 56.38 2wdh s GLN 13 Cb -0.11 0.29 -0.02 0.00 1.00 0.00 0.00 33.01 34.17 2wdh s GLN 13 CO 0.46 -0.12 -0.16 0.14 -2.12 0.00 0.00 175.29 173.48 2wdh s VAL 14 N -0.35 1.31 -0.03 1.09 -7.23 -1.21 -5.03 120.40 108.94 2wdh s VAL 14 Ca -0.05 -1.08 -0.00 0.00 -1.81 0.00 0.00 61.98 59.04 2wdh s VAL 14 Cb -0.03 -1.17 -0.00 0.00 0.56 0.00 0.00 36.38 35.74 2wdh s VAL 14 CO 0.03 0.07 -0.01 0.00 -0.31 0.00 0.00 175.10 174.88 2wdh h ALA 15 N 4.89 0.00 -2.15 1.32 0.00 -1.88 -3.24 119.26 118.21 2wdh h ALA 15 Ca -0.40 -0.03 -0.57 0.00 0.00 0.00 0.00 54.91 53.91 2wdh h ALA 15 Cb 1.17 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.93 2wdh h ALA 15 CO 0.44 0.01 0.76 0.45 0.00 0.00 0.00 179.25 180.91 2wdh s SER 16 N -3.85 7.10 0.00 0.00 0.15 -1.26 0.07 113.70 115.90 2wdh s SER 16 Ca -0.00 1.50 0.00 0.00 0.70 0.00 0.00 55.95 58.15 2wdh s SER 16 Cb 0.00 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.77 2wdh s SER 16 CO 0.01 -0.63 0.00 0.61 1.20 0.00 0.00 173.24 174.42 2wdh n GLY 17 N 3.33 7.46 3.29 9.45 0.00 0.20 -4.19 105.19 124.72 2wdh n GLY 17 Ca 0.12 -1.95 -0.10 0.00 0.00 0.00 0.00 46.02 44.09 2wdh n GLY 17 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2wdh s ARG 18 N 0.96 0.39 -0.10 1.61 3.52 -1.25 -2.71 118.95 121.38 2wdh s ARG 18 Ca 0.00 0.86 -0.05 0.00 -0.13 0.00 0.00 55.73 56.41 2wdh s ARG 18 Cb 0.00 0.05 -0.04 0.00 -1.56 0.00 0.00 34.95 33.40 2wdh s ARG 18 CO 0.00 -0.18 0.08 0.00 -0.81 0.00 0.00 175.30 174.40 2wdh s ALA 19 N 1.64 3.64 -0.14 6.12 0.00 0.45 -0.42 121.76 133.05 2wdh s ALA 19 Ca -0.08 -0.72 0.01 0.00 0.00 0.00 0.00 51.96 51.17 2wdh s ALA 19 Cb -0.09 -1.76 0.02 0.00 0.00 0.00 0.00 23.12 21.29 2wdh s ALA 19 CO -0.13 0.61 -0.15 0.71 0.00 0.00 0.00 175.76 176.80 2wdh s TYR 20 N -0.99 2.20 -0.19 0.00 1.51 0.39 -0.62 117.35 119.65 2wdh s TYR 20 Ca 0.15 -1.20 -0.02 0.00 -1.01 0.00 0.00 57.07 54.99 2wdh s TYR 20 Cb -0.12 -1.60 -0.01 0.00 -0.11 0.00 0.00 41.96 40.13 2wdh s TYR 20 CO 0.04 -0.64 -0.09 0.42 -1.11 0.00 0.00 175.55 174.18 2wdh s ILE 21 N 1.33 3.14 -0.45 2.71 1.09 -0.20 0.56 121.20 129.38 2wdh s ILE 21 Ca 0.02 -0.59 -0.11 0.00 -1.10 0.00 0.00 60.65 58.87 2wdh s ILE 21 Cb -0.13 -2.39 0.09 0.00 -1.06 0.00 0.00 42.46 38.97 2wdh s ILE 21 CO -0.08 0.47 0.33 -2.28 -0.10 0.00 0.00 174.94 173.27 2wdh s HIS 22 N 1.12 3.32 -0.60 3.97 2.46 0.20 -1.65 115.29 124.11 2wdh s HIS 22 Ca 0.01 -1.40 -0.28 0.00 0.47 0.00 0.00 55.06 53.86 2wdh s HIS 22 Cb -0.14 -3.17 0.03 0.00 -0.13 0.00 0.00 32.58 29.16 2wdh s HIS 22 CO -0.02 -0.87 1.26 0.00 -2.47 0.00 0.00 174.74 172.64 2wdh s ALA 23 N 1.49 2.91 0.00 1.58 0.00 0.14 -2.84 121.76 125.03 2wdh s ALA 23 Ca 0.04 -0.88 0.00 0.00 0.00 0.00 0.00 51.96 51.11 2wdh s ALA 23 Cb -0.24 -4.09 0.00 0.00 0.00 0.00 0.00 23.12 18.78 2wdh s ALA 23 CO 0.03 -2.84 0.00 0.45 0.00 0.00 0.00 175.76 173.40 2wdh n SER 24 N 8.87 0.21 0.00 0.00 2.88 -1.23 -4.00 113.62 120.35 2wdh n SER 24 Ca 0.08 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.62 2wdh n SER 24 Cb 0.49 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.95 2wdh n SER 24 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 2wdh n TYR 25 N 0.00 0.00 -0.43 0.66 4.02 -1.26 -4.09 117.16 116.05 2wdh n TYR 25 Ca 0.00 0.00 0.10 0.00 -0.01 0.00 0.00 57.90 57.99 2wdh n TYR 25 Cb 0.00 0.04 0.34 0.00 -0.02 0.00 0.00 39.34 39.70 2wdh n TYR 25 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 2wdh n ASN 26 N -2.23 4.38 0.00 7.72 3.02 -1.26 -4.37 115.26 122.52 2wdh n ASN 26 Ca 0.00 -2.31 0.00 0.00 -0.03 0.00 0.00 54.58 52.24 2wdh n ASN 26 Cb 0.30 -0.54 0.00 0.00 -0.61 0.00 0.00 39.78 38.92 2wdh n ASN 26 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2wdh n ASN 27 N 1.22 0.00 -3.94 6.41 5.15 -1.25 -4.02 115.26 118.82 2wdh n ASN 27 Ca 0.24 0.00 -0.13 0.00 -0.60 0.00 0.00 54.58 54.10 2wdh n ASN 27 Cb 0.79 0.00 -0.13 0.00 -0.53 0.00 0.00 39.78 39.91 2wdh n ASN 27 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2wdh s THR 28 N -2.00 0.23 -0.02 -0.44 2.01 -1.14 -3.47 115.64 110.80 2wdh s THR 28 Ca 0.00 -0.38 0.01 0.00 0.31 0.00 0.00 61.69 61.63 2wdh s THR 28 Cb 0.00 -0.25 0.02 0.00 0.01 0.00 0.00 72.50 72.28 2wdh s THR 28 CO 0.00 -0.10 -0.03 -0.51 -0.69 0.00 0.00 174.62 173.29 2wdh s ILE 29 N -0.48 0.35 -0.07 1.82 1.10 -1.13 -0.36 121.20 122.43 2wdh s ILE 29 Ca -0.03 -0.07 0.04 0.00 -0.51 0.00 0.00 60.65 60.07 2wdh s ILE 29 Cb -0.04 -0.37 -0.00 0.00 0.15 0.00 0.00 42.46 42.20 2wdh s ILE 29 CO -0.00 0.15 -0.21 0.68 -2.11 0.00 0.00 174.94 173.45 2wdh s VAL 30 N 0.60 1.80 -0.07 4.00 -7.23 0.21 0.61 120.40 120.32 2wdh s VAL 30 Ca -0.07 -0.89 0.01 0.00 -1.81 0.00 0.00 61.98 59.22 2wdh s VAL 30 Cb -0.10 -1.55 0.02 0.00 0.56 0.00 0.00 36.38 35.31 2wdh s VAL 30 CO -0.01 0.50 -0.06 0.28 -0.31 0.00 0.00 175.10 175.50 2wdh s THR 31 N 0.22 0.76 -0.27 5.32 -1.32 0.19 0.57 115.64 121.11 2wdh s THR 31 Ca -0.12 -0.21 -0.08 0.00 -1.21 0.00 0.00 61.69 60.07 2wdh s THR 31 Cb -0.15 -0.78 -0.02 0.00 -1.51 0.00 0.00 72.50 70.04 2wdh s THR 31 CO 0.06 0.29 0.10 0.27 -2.21 0.00 0.00 174.62 173.13 2wdh s ILE 32 N 1.19 4.47 0.00 5.08 -4.36 0.15 -0.46 121.20 127.27 2wdh s ILE 32 Ca -0.06 -0.23 0.00 0.00 -0.26 0.00 0.00 60.65 60.10 2wdh s ILE 32 Cb -0.14 -3.16 0.00 0.00 1.25 0.00 0.00 42.46 40.41 2wdh s ILE 32 CO -0.02 0.24 0.00 0.35 0.24 0.00 0.00 174.94 175.76 2wdh n THR 33 N 4.95 0.00 -3.40 8.37 -2.24 0.44 -0.91 114.28 121.49 2wdh n THR 33 Ca -0.15 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 2wdh n THR 33 Cb 0.51 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.47 2wdh n THR 33 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2wdh n ASP 34 N 0.00 1.41 -0.28 3.42 3.85 -1.22 -3.78 116.55 119.95 2wdh n ASP 34 Ca 0.00 -0.40 -0.04 0.00 -0.71 0.00 0.00 54.79 53.64 2wdh n ASP 34 Cb 0.00 0.00 0.10 0.00 -1.35 0.00 0.00 41.12 39.87 2wdh n ASP 34 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.20 175.54 2wdh h PRO 35 N 0.00 1.16 0.35 0.11 0.11 -1.88 -3.17 132.00 128.67 2wdh h PRO 35 Ca 0.00 -0.18 -0.02 0.00 0.11 0.00 0.00 66.00 65.91 2wdh h PRO 35 Cb 0.00 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 30.91 2wdh h PRO 35 CO 0.00 0.91 -0.17 -0.44 -0.21 0.00 0.00 178.00 178.09 2wdh h ASP 36 N 1.14 -0.40 0.00 -2.05 3.45 -1.96 -3.48 116.42 113.12 2wdh h ASP 36 Ca 0.27 -0.14 0.00 0.00 0.43 0.00 0.00 57.03 57.59 2wdh h ASP 36 Cb 0.16 0.10 0.00 0.00 -0.56 0.00 0.00 39.33 39.03 2wdh h ASP 36 CO -0.03 -0.06 0.00 0.61 -1.57 0.00 0.00 179.24 178.19 2wdh n GLY 37 N -0.48 0.15 3.47 2.75 0.00 -1.20 -5.13 105.19 104.75 2wdh n GLY 37 Ca -0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 2wdh n GLY 37 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wdh s ASN 38 N -0.15 6.03 0.02 1.61 0.02 -1.26 -4.74 114.94 116.47 2wdh s ASN 38 Ca 0.00 -0.78 -0.19 0.00 -1.02 0.00 0.00 52.86 50.87 2wdh s ASN 38 Cb 0.00 -2.13 -0.10 0.00 0.02 0.00 0.00 41.25 39.04 2wdh s ASN 38 CO 0.00 -0.38 0.49 -2.65 0.02 0.00 0.00 177.10 174.57 2wdh n PRO 39 N 5.12 0.00 -0.06 -0.60 -0.02 -1.26 -3.41 135.00 134.77 2wdh n PRO 39 Ca -0.12 0.00 -0.12 0.00 -2.02 0.00 0.00 63.50 61.24 2wdh n PRO 39 Cb 0.48 -0.71 -0.05 0.00 -0.02 0.00 0.00 33.50 33.19 2wdh n PRO 39 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 2wdh n ILE 40 N 0.60 0.72 -3.55 4.25 2.08 -0.09 -4.91 119.36 118.46 2wdh n ILE 40 Ca 0.10 -0.22 -0.10 0.00 0.56 0.00 0.00 62.75 63.09 2wdh n ILE 40 Cb 0.06 -1.38 -0.04 0.00 -0.75 0.00 0.00 39.64 37.53 2wdh n ILE 40 CO 0.00 0.00 0.00 -0.89 0.56 0.00 0.00 176.55 176.22 2wdh s THR 41 N -2.24 0.00 0.19 1.39 2.01 -1.15 -5.04 115.64 110.79 2wdh s THR 41 Ca -0.18 0.00 -0.01 0.00 0.31 0.00 0.00 61.69 61.81 2wdh s THR 41 Cb 0.06 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.53 2wdh s THR 41 CO 0.25 0.00 0.12 -1.66 -0.69 0.00 0.00 174.62 172.65 2wdh s TRP 42 N -1.84 1.08 -0.12 4.92 1.48 -1.26 -0.67 118.94 122.52 2wdh s TRP 42 Ca 0.00 -1.33 -0.29 0.00 -1.06 0.00 0.00 56.10 53.42 2wdh s TRP 42 Cb -0.01 -0.52 0.07 0.00 -1.16 0.00 0.00 33.47 31.85 2wdh s TRP 42 CO -0.02 -0.63 0.71 0.45 -4.06 0.00 0.00 176.95 173.40 2wdh s SER 43 N -3.13 -0.68 0.18 -2.66 0.15 0.19 -4.80 113.70 102.96 2wdh s SER 43 Ca 0.36 0.94 -0.00 0.00 0.70 0.00 0.00 55.95 57.94 2wdh s SER 43 Cb 0.07 0.82 -0.04 0.00 -1.71 0.00 0.00 66.02 65.16 2wdh s SER 43 CO 0.10 -0.49 0.08 -0.94 1.20 0.00 0.00 173.24 173.19 2wdh s SER 44 N -0.69 0.59 0.64 5.45 1.04 -1.26 0.68 113.70 120.14 2wdh s SER 44 Ca -0.07 -1.29 0.31 0.00 0.48 0.00 0.00 55.95 55.37 2wdh s SER 44 Cb -0.02 0.27 1.67 0.00 0.10 0.00 0.00 66.02 68.04 2wdh s SER 44 CO 0.07 -0.73 1.99 1.23 0.98 0.00 0.00 173.24 176.77 2wdh h GLY 45 N 2.67 0.00 1.49 7.32 0.00 -0.95 0.21 103.07 113.81 2wdh h GLY 45 Ca -0.36 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 46.68 2wdh h GLY 45 CO 0.58 0.00 -1.34 -1.33 0.00 0.00 0.00 176.54 174.45 2wdh h GLY 46 N 0.00 0.35 1.99 4.60 0.00 -1.84 -3.24 103.07 104.93 2wdh h GLY 46 Ca 0.06 -0.89 -0.01 0.00 0.00 0.00 0.00 47.33 46.49 2wdh h GLY 46 CO -0.00 0.78 -0.06 -2.08 0.00 0.00 0.00 176.54 175.17 2wdh h VAL 47 N 0.08 1.05 -3.10 4.60 2.07 -0.83 -3.38 116.25 116.73 2wdh h VAL 47 Ca -0.18 -0.23 -0.25 0.00 0.82 0.00 0.00 66.70 66.86 2wdh h VAL 47 Cb 2.01 1.11 0.10 0.00 -1.52 0.00 0.00 31.29 33.00 2wdh h VAL 47 CO 0.20 0.07 0.24 -0.38 0.02 0.00 0.00 177.57 177.72 2wdh n ILE 48 N -4.46 0.00 -1.43 4.57 2.08 -1.04 -4.88 119.36 114.20 2wdh n ILE 48 Ca -0.03 -0.58 -0.39 0.00 0.56 0.00 0.00 62.75 62.31 2wdh n ILE 48 Cb 0.15 -1.70 -0.02 0.00 -0.75 0.00 0.00 39.64 37.31 2wdh n ILE 48 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2wdh n GLY 49 N -0.04 4.20 3.45 7.39 0.00 -1.26 -4.83 105.19 114.10 2wdh n GLY 49 Ca 0.10 -1.49 -0.16 0.00 0.00 0.00 0.00 46.02 44.46 2wdh n GLY 49 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wdh s TYR 50 N 2.69 -0.54 0.11 1.61 4.12 -1.23 -5.10 117.35 119.00 2wdh s TYR 50 Ca 0.60 0.87 -0.25 0.00 0.02 0.00 0.00 57.07 58.30 2wdh s TYR 50 Cb 0.16 0.35 0.08 0.00 -1.52 0.00 0.00 41.96 41.03 2wdh s TYR 50 CO -0.06 -0.58 0.79 -1.59 0.02 0.00 0.00 175.55 174.12 2wdh s LYS 51 N -1.44 1.14 3.99 -0.62 0.00 -1.26 -3.74 119.74 117.81 2wdh s LYS 51 Ca -0.10 -0.49 0.00 0.00 0.00 0.00 0.00 55.97 55.37 2wdh s LYS 51 Cb -0.01 0.48 0.00 0.00 0.00 0.00 0.00 37.83 38.30 2wdh s LYS 51 CO 0.07 -0.51 0.00 0.41 0.00 0.00 0.00 175.35 175.32 2wdh n GLY 52 N -0.35 1.00 0.08 0.59 0.00 -1.26 -3.76 105.19 101.49 2wdh n GLY 52 Ca -0.10 -0.89 0.05 0.00 0.00 0.00 0.00 46.02 45.08 2wdh n GLY 52 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2wdh n SER 53 N 4.58 0.55 0.00 1.61 3.41 -1.26 -3.90 113.62 118.60 2wdh n SER 53 Ca 0.00 0.23 0.05 0.00 -0.26 0.00 0.00 58.87 58.88 2wdh n SER 53 Cb 0.00 0.81 0.28 0.00 -0.26 0.00 0.00 64.21 65.04 2wdh n SER 53 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2wdh n ARG 54 N -2.65 0.39 0.12 4.33 1.74 -1.25 -1.72 116.66 117.62 2wdh n ARG 54 Ca -0.08 0.00 0.12 0.00 -0.77 0.00 0.00 57.85 57.12 2wdh n ARG 54 Cb 0.71 -1.38 0.08 0.00 -1.02 0.00 0.00 32.46 30.85 2wdh n ARG 54 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 2wdh h LYS 55 N 0.00 0.00 -0.00 5.56 1.57 -1.78 -3.16 116.57 118.77 2wdh h LYS 55 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2wdh h LYS 55 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2wdh h LYS 55 CO 0.00 0.00 -0.19 0.41 -0.57 0.00 0.00 179.45 179.10 2wdh n GLY 56 N 1.20 -1.38 3.69 3.86 0.00 -0.70 -2.89 105.19 108.97 2wdh n GLY 56 Ca 0.02 -0.20 -0.44 0.00 0.00 0.00 0.00 46.02 45.40 2wdh n GLY 56 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2wdh n THR 57 N -1.48 0.71 0.31 2.61 -1.04 -1.19 -3.42 114.28 110.78 2wdh n THR 57 Ca 0.07 -0.18 0.20 0.00 -2.04 0.00 0.00 64.05 62.10 2wdh n THR 57 Cb 0.33 -1.64 1.01 0.00 -1.82 0.00 0.00 70.33 68.21 2wdh n THR 57 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 2wdh h PRO 58 N 4.87 0.00 -0.00 -2.82 0.13 -1.90 -0.75 132.00 131.52 2wdh h PRO 58 Ca -0.45 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.47 2wdh h PRO 58 Cb 1.25 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.38 2wdh h PRO 58 CO 0.81 0.01 -0.88 -0.92 -0.23 0.00 0.00 178.00 176.79 2wdh h TYR 59 N 0.00 0.40 0.05 1.56 3.20 -1.93 -2.51 116.97 117.74 2wdh h TYR 59 Ca -0.00 -0.21 -0.26 0.00 3.14 0.00 0.00 58.73 61.40 2wdh h TYR 59 Cb 0.19 -0.05 0.02 0.00 1.54 0.00 0.00 36.73 38.44 2wdh h TYR 59 CO 0.00 1.02 -1.05 0.00 -1.64 0.00 0.00 178.16 176.49 2wdh h ALA 60 N 0.91 0.06 0.00 1.82 0.00 -1.55 0.42 119.26 120.93 2wdh h ALA 60 Ca -0.05 -0.71 0.00 0.00 0.00 0.00 0.00 54.91 54.15 2wdh h ALA 60 Cb 1.50 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.37 2wdh h ALA 60 CO 0.14 0.62 0.00 0.00 0.00 0.00 0.00 179.25 180.01 2wdh n ALA 61 N -2.65 1.37 -0.10 0.00 0.00 -0.40 -0.33 120.51 118.41 2wdh n ALA 61 Ca -0.12 -0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.15 2wdh n ALA 61 Cb 0.89 -1.17 -0.08 0.00 0.00 0.00 0.00 19.45 19.09 2wdh n ALA 61 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2wdh n GLN 62 N -1.63 0.47 0.00 0.00 7.27 -0.95 -3.57 117.38 118.98 2wdh n GLN 62 Ca 0.02 0.15 0.05 0.00 0.07 0.00 0.00 57.00 57.28 2wdh n GLN 62 Cb 0.10 -1.33 0.25 0.00 2.41 0.00 0.00 30.24 31.68 2wdh n GLN 62 CO 0.00 0.00 0.00 -0.11 0.07 0.00 0.00 177.06 177.02 2wdh n LEU 63 N -3.43 0.00 -0.10 1.69 0.00 0.15 -2.47 117.00 112.83 2wdh n LEU 63 Ca -0.37 0.29 -0.15 0.00 0.00 0.00 0.00 56.01 55.78 2wdh n LEU 63 Cb 0.83 -0.29 -0.06 0.00 0.00 0.00 0.00 43.42 43.91 2wdh n LEU 63 CO 0.12 -0.20 -0.73 0.00 0.00 0.00 0.00 177.39 176.58 2wdh n ALA 64 N -1.29 0.81 -0.15 1.96 0.00 0.56 -3.82 120.51 118.59 2wdh n ALA 64 Ca 0.05 -0.71 0.28 0.00 0.00 0.00 0.00 53.44 53.05 2wdh n ALA 64 Cb 0.08 -0.06 0.72 0.00 0.00 0.00 0.00 19.45 20.19 2wdh n ALA 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wdh h ALA 65 N -0.91 2.74 -0.04 0.00 0.00 -1.55 0.28 119.26 119.78 2wdh h ALA 65 Ca -0.22 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 2wdh h ALA 65 Cb 1.06 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2wdh h ALA 65 CO -0.13 -1.11 -0.09 -0.07 0.00 0.00 0.00 179.25 177.85 2wdh h LEU 66 N 0.00 0.15 -0.82 0.00 3.38 -1.67 0.34 115.31 116.69 2wdh h LEU 66 Ca 0.40 -0.58 0.06 0.00 0.09 0.00 0.00 57.88 57.86 2wdh h LEU 66 Cb 1.75 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 42.40 2wdh h LEU 66 CO -0.00 0.70 0.50 -0.78 0.09 0.00 0.00 178.44 178.94 2wdh h ASP 67 N -0.40 0.78 0.32 -0.43 -0.00 -0.64 0.47 116.42 116.53 2wdh h ASP 67 Ca 0.00 0.02 -0.02 0.00 -0.00 0.00 0.00 57.03 57.03 2wdh h ASP 67 Cb 0.68 -0.14 0.00 0.00 -0.00 0.00 0.00 39.33 39.87 2wdh h ASP 67 CO 0.02 0.50 -0.16 0.00 -0.00 0.00 0.00 179.24 179.60 2wdh h ALA 68 N 1.39 -0.43 0.07 -0.78 0.00 -1.02 -1.48 119.26 117.01 2wdh h ALA 68 Ca 0.36 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.17 2wdh h ALA 68 Cb 0.18 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 2wdh h ALA 68 CO -0.18 -0.73 -0.42 0.00 0.00 0.00 0.00 179.25 177.93 2wdh h ALA 69 N 0.20 -0.89 -0.16 0.00 0.00 0.13 -0.78 119.26 117.75 2wdh h ALA 69 Ca -0.04 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.81 2wdh h ALA 69 Cb 0.36 0.82 -0.04 0.00 0.00 0.00 0.00 17.79 18.92 2wdh h ALA 69 CO 0.07 -1.00 -0.35 -0.22 0.00 0.00 0.00 179.25 177.75 2wdh h LYS 70 N -0.58 -0.30 -1.05 0.00 3.64 -0.07 -0.38 116.57 117.84 2wdh h LYS 70 Ca -0.00 0.02 0.28 0.00 -1.27 0.00 0.00 60.65 59.67 2wdh h LYS 70 Cb 0.59 0.07 -0.11 0.00 -0.41 0.00 0.00 32.23 32.37 2wdh h LYS 70 CO -0.24 -0.20 0.65 0.87 -2.27 0.00 0.00 179.45 178.26 2wdh h LYS 71 N -0.32 0.42 -0.32 1.90 1.57 -1.18 0.57 116.57 119.21 2wdh h LYS 71 Ca 0.03 -0.02 -0.13 0.00 -1.87 0.00 0.00 60.65 58.66 2wdh h LYS 71 Cb 0.40 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 2wdh h LYS 71 CO -0.32 0.27 -0.32 0.00 -0.57 0.00 0.00 179.45 178.52 2wdh h ALA 72 N 1.67 0.83 0.00 3.86 0.00 0.40 -3.15 119.26 122.87 2wdh h ALA 72 Ca 0.64 -0.41 -0.09 0.00 0.00 0.00 0.00 54.91 55.05 2wdh h ALA 72 Cb 1.50 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 2wdh h ALA 72 CO -0.38 0.64 -0.41 0.52 0.00 0.00 0.00 179.25 179.61 2wdh h MET 73 N 0.60 0.00 0.00 0.00 2.86 0.64 -1.66 114.93 117.36 2wdh h MET 73 Ca 0.07 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 2wdh h MET 73 Cb 0.84 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.50 2wdh h MET 73 CO 0.07 0.41 0.00 0.00 1.06 0.00 0.00 176.91 178.46 2wdh n ALA 74 N -2.39 1.86 0.29 6.32 0.00 -1.04 0.47 120.51 126.02 2wdh n ALA 74 Ca -0.01 -0.07 0.06 0.00 0.00 0.00 0.00 53.44 53.42 2wdh n ALA 74 Cb 0.48 -1.20 0.09 0.00 0.00 0.00 0.00 19.45 18.81 2wdh n ALA 74 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2wdh n TYR 75 N -1.12 0.16 -1.21 0.00 4.02 -0.64 -4.97 117.16 113.39 2wdh n TYR 75 Ca 0.08 -0.16 0.00 0.00 -0.01 0.00 0.00 57.90 57.81 2wdh n TYR 75 Cb 0.07 -0.01 0.00 0.00 -0.02 0.00 0.00 39.34 39.38 2wdh n TYR 75 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2wdh n GLY 76 N 0.66 0.71 3.75 2.72 0.00 0.18 -3.28 105.19 109.92 2wdh n GLY 76 Ca 0.09 -0.71 -0.41 0.00 0.00 0.00 0.00 46.02 44.99 2wdh n GLY 76 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2wdh s MET 77 N -2.58 4.44 0.00 1.61 0.00 -1.08 -3.82 119.30 117.87 2wdh s MET 77 Ca 0.00 2.02 0.00 0.00 0.00 0.00 0.00 55.69 57.71 2wdh s MET 77 Cb 0.00 -3.18 0.00 0.00 0.00 0.00 0.00 34.83 31.65 2wdh s MET 77 CO 0.00 -0.14 0.00 1.04 0.00 0.00 0.00 175.02 175.92 2wdh n GLN 78 N 1.99 0.00 -3.98 4.11 1.13 0.11 -4.65 117.38 116.09 2wdh n GLN 78 Ca 0.03 0.00 -0.30 0.00 -1.94 0.00 0.00 57.00 54.79 2wdh n GLN 78 Cb 0.43 0.00 -0.05 0.00 0.11 0.00 0.00 30.24 30.73 2wdh n GLN 78 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 2wdh s SER 79 N -3.64 5.98 -0.14 1.08 1.04 -1.18 -1.74 113.70 115.09 2wdh s SER 79 Ca 0.00 0.14 -0.06 0.00 0.48 0.00 0.00 55.95 56.51 2wdh s SER 79 Cb 0.00 -1.74 0.07 0.00 0.10 0.00 0.00 66.02 64.45 2wdh s SER 79 CO 0.00 0.16 0.31 0.68 0.98 0.00 0.00 173.24 175.37 2wdh s VAL 80 N -1.47 -0.37 0.10 5.02 -7.23 -0.57 0.58 120.40 116.45 2wdh s VAL 80 Ca 0.32 0.22 -0.30 0.00 -1.81 0.00 0.00 61.98 60.41 2wdh s VAL 80 Cb -0.12 -0.49 -0.06 0.00 0.56 0.00 0.00 36.38 36.27 2wdh s VAL 80 CO 0.25 0.09 1.01 -1.81 -0.31 0.00 0.00 175.10 174.34 2wdh s ASP 81 N 2.19 7.40 -0.01 4.85 1.11 -1.10 -2.27 116.67 128.84 2wdh s ASP 81 Ca -0.02 1.84 -0.01 0.00 0.18 0.00 0.00 52.55 54.54 2wdh s ASP 81 Cb -0.11 -2.59 -0.04 0.00 1.07 0.00 0.00 42.92 41.25 2wdh s ASP 81 CO -0.10 -0.17 0.09 -0.69 1.18 0.00 0.00 175.17 175.48 2wdh s VAL 82 N 0.24 4.80 -0.07 -1.27 1.01 -0.60 -0.41 120.40 124.10 2wdh s VAL 82 Ca 0.49 -0.35 -0.01 0.00 0.00 0.00 0.00 61.98 62.11 2wdh s VAL 82 Cb -0.25 -3.19 0.03 0.00 0.00 0.00 0.00 36.38 32.98 2wdh s VAL 82 CO 0.30 0.37 0.01 -0.63 0.00 0.00 0.00 175.10 175.15 2wdh s ILE 83 N -1.18 0.34 0.03 2.22 1.01 0.21 -1.02 121.20 122.81 2wdh s ILE 83 Ca 0.22 0.14 0.01 0.00 0.00 0.00 0.00 60.65 61.03 2wdh s ILE 83 Cb -0.12 -0.50 -0.04 0.00 0.01 0.00 0.00 42.46 41.81 2wdh s ILE 83 CO 0.13 0.25 0.06 0.68 0.00 0.00 0.00 174.94 176.06 2wdh s VAL 84 N 1.97 4.48 -0.09 2.92 -7.23 0.33 -1.03 120.40 121.76 2wdh s VAL 84 Ca 0.05 -0.60 -0.02 0.00 -1.81 0.00 0.00 61.98 59.60 2wdh s VAL 84 Cb -0.12 -3.07 0.03 0.00 0.56 0.00 0.00 36.38 33.78 2wdh s VAL 84 CO -0.05 0.28 0.02 -0.13 -0.31 0.00 0.00 175.10 174.91 2wdh s ARG 85 N -1.91 0.45 0.00 4.82 0.52 -0.66 -1.01 118.95 121.16 2wdh s ARG 85 Ca 0.24 0.07 0.00 0.00 -0.52 0.00 0.00 55.73 55.52 2wdh s ARG 85 Cb -0.12 -1.10 0.00 0.00 0.52 0.00 0.00 34.95 34.25 2wdh s ARG 85 CO 0.16 -0.38 0.00 0.41 0.02 0.00 0.00 175.30 175.51 2wdh n GLY 86 N 5.17 -1.04 3.89 -3.53 0.00 -1.26 0.25 105.19 108.67 2wdh n GLY 86 Ca -0.07 -1.64 -0.29 0.00 0.00 0.00 0.00 46.02 44.02 2wdh n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wdh s THR 87 N -1.92 4.52 -0.24 2.61 2.01 -1.26 -4.55 115.64 116.81 2wdh s THR 87 Ca 0.00 0.54 -0.27 0.00 0.31 0.00 0.00 61.69 62.27 2wdh s THR 87 Cb 0.00 -3.78 0.15 0.00 0.01 0.00 0.00 72.50 68.88 2wdh s THR 87 CO 0.00 -0.93 1.14 -0.83 -0.69 0.00 0.00 174.62 173.31 2wdh s GLY 88 N -4.19 -0.07 0.25 4.40 0.00 -1.26 -3.61 107.32 102.84 2wdh s GLY 88 Ca 0.53 2.63 -0.05 0.00 0.00 0.00 0.00 44.72 47.83 2wdh s GLY 88 CO 0.50 1.48 1.88 0.00 0.00 0.00 0.00 173.10 176.96 2wdh h ALA 89 N 3.16 1.22 -0.62 3.20 0.00 -1.75 -2.47 119.26 121.99 2wdh h ALA 89 Ca -0.22 -0.12 -0.43 0.00 0.00 0.00 0.00 54.91 54.14 2wdh h ALA 89 Cb 1.18 -0.35 -0.29 0.00 0.00 0.00 0.00 17.79 18.33 2wdh h ALA 89 CO 0.20 0.64 -0.33 0.41 0.00 0.00 0.00 179.25 180.17 2wdh n GLY 90 N -1.17 5.85 0.15 0.00 0.00 -1.22 -4.27 105.19 104.53 2wdh n GLY 90 Ca 0.09 -2.14 -0.11 0.00 0.00 0.00 0.00 46.02 43.87 2wdh n GLY 90 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2wdh h ARG 91 N 1.76 -0.27 0.00 1.61 1.12 -1.80 -2.92 114.38 113.88 2wdh h ARG 91 Ca 0.34 0.02 -0.08 0.00 -1.11 0.00 0.00 59.98 59.14 2wdh h ARG 91 Cb 1.40 0.06 -0.01 0.00 -0.01 0.00 0.00 29.97 31.40 2wdh h ARG 91 CO 0.74 0.12 -0.40 1.49 -3.11 0.00 0.00 179.97 178.81 2wdh h GLU 92 N -0.87 0.00 0.00 0.20 4.57 -1.85 -2.97 114.58 113.65 2wdh h GLU 92 Ca -0.03 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.15 2wdh h GLU 92 Cb 0.51 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.10 2wdh h GLU 92 CO 0.05 0.40 0.00 1.96 -1.18 0.00 0.00 179.01 180.24 2wdh h GLN 93 N 0.00 0.00 0.00 1.92 1.08 -1.88 -2.73 115.11 113.50 2wdh h GLN 93 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2wdh h GLN 93 Cb 0.95 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.38 2wdh h GLN 93 CO 0.05 0.00 0.00 0.00 -0.95 0.00 0.00 178.83 177.93 2wdh h ALA 94 N 2.04 1.00 0.00 3.87 0.00 -1.34 -2.80 119.26 122.03 2wdh h ALA 94 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 2wdh h ALA 94 Cb 0.72 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2wdh h ALA 94 CO 0.00 0.00 -0.38 0.82 0.00 0.00 0.00 179.25 179.69 2wdh h ILE 95 N 0.00 1.02 0.00 0.00 1.08 -1.56 -3.30 117.51 114.75 2wdh h ILE 95 Ca 0.00 -1.89 0.00 0.00 -0.39 0.00 0.00 64.86 62.58 2wdh h ILE 95 Cb 0.94 2.05 0.00 0.00 -3.07 0.00 0.00 36.82 36.74 2wdh h ILE 95 CO 0.00 0.35 0.00 0.03 -0.69 0.00 0.00 178.15 177.84 2wdh h ARG 96 N -1.00 0.00 0.00 2.37 3.08 -1.57 0.15 114.38 117.41 2wdh h ARG 96 Ca -0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.96 2wdh h ARG 96 Cb 0.83 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.88 2wdh h ARG 96 CO -0.05 0.00 -0.10 0.00 -1.07 0.00 0.00 179.97 178.75 2wdh h ALA 97 N 2.00 0.95 0.01 0.04 0.00 -1.61 -3.19 119.26 117.47 2wdh h ALA 97 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.57 2wdh h ALA 97 Cb 0.05 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.78 2wdh h ALA 97 CO 0.00 0.00 -2.09 1.28 0.00 0.00 0.00 179.25 178.44 2wdh n LEU 98 N -2.91 0.97 -0.06 0.00 4.77 0.33 -4.13 117.00 115.97 2wdh n LEU 98 Ca 0.04 0.17 -0.10 0.00 -0.03 0.00 0.00 56.01 56.09 2wdh n LEU 98 Cb 0.51 0.03 -0.07 0.00 -2.33 0.00 0.00 43.42 41.56 2wdh n LEU 98 CO 0.34 0.55 0.50 1.56 -1.33 0.00 0.00 177.39 179.01 2wdh h GLN 99 N 0.01 -0.33 -4.12 3.23 1.08 -1.00 -3.21 115.11 110.77 2wdh h GLN 99 Ca -0.44 0.02 -0.73 0.00 -1.45 0.00 0.00 58.65 56.05 2wdh h GLN 99 Cb 2.10 0.07 -0.29 0.00 -0.05 0.00 0.00 27.48 29.31 2wdh h GLN 99 CO 0.04 -0.22 -0.30 0.00 -0.95 0.00 0.00 178.83 177.40 2wdh s ALA 100 N -5.08 3.54 -0.05 3.87 0.00 -1.21 -4.62 121.76 118.22 2wdh s ALA 100 Ca -0.10 -2.74 0.02 0.00 0.00 0.00 0.00 51.96 49.13 2wdh s ALA 100 Cb 0.06 -2.95 0.06 0.00 0.00 0.00 0.00 23.12 20.29 2wdh s ALA 100 CO 0.43 -2.00 0.96 -1.13 0.00 0.00 0.00 175.76 174.03 2wdh n SER 101 N 4.63 -0.94 -3.52 0.00 3.41 -1.21 -4.77 113.62 111.22 2wdh n SER 101 Ca -0.03 -1.80 -0.25 0.00 -0.26 0.00 0.00 58.87 56.52 2wdh n SER 101 Cb 0.41 0.32 0.05 0.00 -0.26 0.00 0.00 64.21 64.73 2wdh n SER 101 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wdh n GLY 102 N -0.22 -0.52 3.15 5.00 0.00 -1.26 -4.82 105.19 106.51 2wdh n GLY 102 Ca -0.23 0.19 -0.13 0.00 0.00 0.00 0.00 46.02 45.86 2wdh n GLY 102 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2wdh s LEU 103 N -7.08 0.89 -0.31 0.99 1.98 -1.26 -4.97 118.68 108.92 2wdh s LEU 103 Ca 0.52 0.55 -0.22 0.00 -2.89 0.00 0.00 54.13 52.09 2wdh s LEU 103 Cb -0.24 0.92 -0.00 0.00 0.66 0.00 0.00 46.19 47.52 2wdh s LEU 103 CO 0.65 -0.10 0.73 -1.58 -1.89 0.00 0.00 176.35 174.16 2wdh s GLN 104 N 0.28 3.91 -1.31 1.98 0.74 -0.71 -4.72 119.66 119.83 2wdh s GLN 104 Ca -0.01 0.45 -0.16 0.00 0.05 0.00 0.00 55.36 55.69 2wdh s GLN 104 Cb -0.03 -3.74 0.01 0.00 1.10 0.00 0.00 33.01 30.35 2wdh s GLN 104 CO -0.01 -0.67 2.08 1.33 -0.55 0.00 0.00 175.29 177.48 2wdh n VAL 105 N 5.52 3.21 -0.48 1.34 0.24 -1.26 -1.51 118.33 125.39 2wdh n VAL 105 Ca 0.02 -2.93 0.43 0.00 -2.04 0.00 0.00 64.34 59.81 2wdh n VAL 105 Cb 0.48 -2.50 0.78 0.00 -1.47 0.00 0.00 33.84 31.14 2wdh n VAL 105 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 2wdh h LYS 106 N 6.74 0.00 -2.31 7.34 3.64 -1.82 -3.44 116.57 126.72 2wdh h LYS 106 Ca 0.51 -0.00 0.20 0.00 -1.27 0.00 0.00 60.65 60.09 2wdh h LYS 106 Cb 0.70 -0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.46 2wdh h LYS 106 CO 1.80 0.00 0.62 0.45 -2.27 0.00 0.00 179.45 180.05 2wdh s SER 107 N -4.64 -0.05 -0.20 4.20 0.15 -1.23 -4.91 113.70 107.02 2wdh s SER 107 Ca -0.05 -0.49 -0.05 0.00 0.70 0.00 0.00 55.95 56.05 2wdh s SER 107 Cb 0.25 0.42 0.10 0.00 -1.71 0.00 0.00 66.02 65.08 2wdh s SER 107 CO 0.84 -0.82 0.39 -0.63 1.20 0.00 0.00 173.24 174.23 2wdh s ILE 108 N -2.48 -0.61 -0.01 6.45 1.01 -1.26 -1.56 121.20 122.74 2wdh s ILE 108 Ca 0.19 0.11 0.05 0.00 0.00 0.00 0.00 60.65 61.00 2wdh s ILE 108 Cb -0.01 -0.69 -0.01 0.00 0.01 0.00 0.00 42.46 41.76 2wdh s ILE 108 CO 0.03 0.02 -0.15 -0.69 0.00 0.00 0.00 174.94 174.15 2wdh s VAL 109 N 2.58 1.15 -0.64 2.92 1.01 -0.18 -4.98 120.40 122.24 2wdh s VAL 109 Ca 0.03 -0.65 -0.09 0.00 0.00 0.00 0.00 61.98 61.26 2wdh s VAL 109 Cb -0.13 -0.96 0.17 0.00 0.00 0.00 0.00 36.38 35.45 2wdh s VAL 109 CO -0.13 0.30 0.53 -0.62 0.00 0.00 0.00 175.10 175.17 2wdh s ASP 110 N -0.41 5.96 -1.02 3.32 2.15 -1.26 -0.51 116.67 124.91 2wdh s ASP 110 Ca 0.05 -2.44 -0.04 0.00 0.43 0.00 0.00 52.55 50.56 2wdh s ASP 110 Cb -0.06 -2.05 0.28 0.00 -0.30 0.00 0.00 42.92 40.80 2wdh s ASP 110 CO -0.00 -0.57 1.22 -0.67 -0.17 0.00 0.00 175.17 174.97 2wdh n ASP 111 N 4.21 5.62 -4.70 -0.34 4.64 -0.18 -4.96 116.55 120.84 2wdh n ASP 111 Ca 0.03 -3.29 -0.36 0.00 -1.38 0.00 0.00 54.79 49.80 2wdh n ASP 111 Cb 0.42 -1.20 -0.08 0.00 -1.04 0.00 0.00 41.12 39.21 2wdh n ASP 111 CO 0.00 0.00 0.00 -0.89 -0.82 0.00 0.00 177.20 175.49 2wdh s THR 112 N -2.21 5.38 -0.19 5.18 2.01 -1.25 -4.49 115.64 120.06 2wdh s THR 112 Ca 0.32 0.24 -0.29 0.00 0.31 0.00 0.00 61.69 62.26 2wdh s THR 112 Cb 0.01 -3.50 -0.05 0.00 0.01 0.00 0.00 72.50 68.97 2wdh s THR 112 CO 0.02 0.40 1.94 -2.16 -0.69 0.00 0.00 174.62 174.12 2wdh s PRO 113 N 0.65 3.53 -0.26 4.92 0.04 -1.26 -4.94 135.00 137.67 2wdh s PRO 113 Ca 0.09 1.93 0.01 0.00 0.04 0.00 0.00 61.00 63.07 2wdh s PRO 113 Cb -0.12 -4.21 0.07 0.00 0.04 0.00 0.00 34.50 30.28 2wdh s PRO 113 CO 0.01 -1.64 -0.01 0.54 0.04 0.00 0.00 177.00 175.94 2wdh s VAL 114 N 6.53 1.51 0.56 -0.36 0.11 -1.26 -5.05 120.40 122.43 2wdh s VAL 114 Ca 0.87 -1.40 -0.20 0.00 -2.93 0.00 0.00 61.98 58.31 2wdh s VAL 114 Cb -0.31 -1.89 -0.05 0.00 -1.53 0.00 0.00 36.38 32.61 2wdh s VAL 114 CO 0.34 -0.27 1.25 -2.16 -3.33 0.00 0.00 175.10 170.94 2wdh s PRO 115 N 1.37 3.15 -0.30 1.54 0.04 -1.26 -4.89 135.00 134.65 2wdh s PRO 115 Ca -0.01 1.96 -0.01 0.00 0.04 0.00 0.00 61.00 62.98 2wdh s PRO 115 Cb -0.19 -2.12 0.23 0.00 0.04 0.00 0.00 34.50 32.46 2wdh s PRO 115 CO -0.09 -1.09 1.95 0.72 0.04 0.00 0.00 177.00 178.52 2wdh n HIS 116 N -1.22 1.53 -1.02 0.56 8.25 -1.26 -4.68 115.22 117.38 2wdh n HIS 116 Ca 0.12 -1.87 0.00 0.00 -0.26 0.00 0.00 57.72 55.71 2wdh n HIS 116 Cb 0.48 -0.91 0.00 0.00 1.12 0.00 0.00 29.99 30.68 2wdh n HIS 116 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2wdh n ASN 117 N 0.27 -1.36 0.00 0.41 5.03 -1.26 -5.12 115.26 113.23 2wdh n ASN 117 Ca 0.30 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.75 2wdh n ASN 117 Cb 0.64 -0.68 0.00 0.00 -1.02 0.00 0.00 39.78 38.71 2wdh n ASN 117 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2wdh n GLY 118 N -0.53 0.10 3.79 7.41 0.00 -1.26 -5.06 105.19 109.64 2wdh n GLY 118 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 2wdh n GLY 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wdh s ARG 120 N -1.72 4.29 0.84 0.00 3.52 -1.26 -4.98 118.95 119.64 2wdh s ARG 120 Ca 0.42 2.24 -0.12 0.00 -0.13 0.00 0.00 55.73 58.15 2wdh s ARG 120 Cb -0.19 -3.13 0.10 0.00 -1.56 0.00 0.00 34.95 30.16 2wdh s ARG 120 CO 0.23 -0.39 1.11 -2.14 -0.81 0.00 0.00 175.30 173.30 2wdh s PRO 121 N -0.20 1.69 0.26 5.12 0.02 -1.26 -5.04 135.00 135.59 2wdh s PRO 121 Ca 0.59 0.55 -0.04 0.00 0.02 0.00 0.00 61.00 62.12 2wdh s PRO 121 Cb -0.41 -1.88 0.07 0.00 0.02 0.00 0.00 34.50 32.30 2wdh s PRO 121 CO 0.41 -1.87 0.15 1.63 -0.33 0.00 0.00 177.00 176.99 2wdh n LYS 122 N -3.59 -2.21 -0.01 5.54 5.02 -1.26 -4.78 118.16 116.88 2wdh n LYS 122 Ca 0.07 -0.25 -0.18 0.00 -2.02 0.00 0.00 58.31 55.92 2wdh n LYS 122 Cb 0.57 -0.34 -0.14 0.00 -0.02 0.00 0.00 35.03 35.10 2wdh n LYS 122 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 2wdh h LYS 123 N 0.00 0.16 -0.81 1.97 3.64 -1.98 -3.10 116.57 116.45 2wdh h LYS 123 Ca -0.07 -0.27 0.11 0.00 -1.27 0.00 0.00 60.65 59.15 2wdh h LYS 123 Cb 0.23 0.10 -0.12 0.00 -0.41 0.00 0.00 32.23 32.03 2wdh h LYS 123 CO 0.04 1.13 -0.38 1.17 -2.27 0.00 0.00 179.45 179.14 2wdh n LYS 124 N -4.29 -0.25 0.00 1.90 4.81 -1.26 0.14 118.16 119.20 2wdh n LYS 124 Ca -0.16 1.24 0.16 0.00 -0.87 0.00 0.00 58.31 58.68 2wdh n LYS 124 Cb 0.70 -1.84 0.86 0.00 0.02 0.00 0.00 35.03 34.77 2wdh n LYS 124 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 2wdh n PHE 125 N -5.13 0.00 1.04 5.64 3.01 -1.25 -3.93 117.46 116.84 2wdh n PHE 125 Ca 0.06 0.00 0.01 0.00 1.01 0.00 0.00 57.45 58.53 2wdh n PHE 125 Cb 0.28 -0.02 0.06 0.00 -0.01 0.00 0.00 39.48 39.79 2wdh n PHE 125 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2wdh n ARG 126 N -0.84 1.50 0.00 -1.08 1.74 0.37 -3.66 116.66 114.69 2wdh n ARG 126 Ca 0.22 -0.48 0.00 0.00 -0.77 0.00 0.00 57.85 56.82 2wdh n ARG 126 Cb 0.16 -1.42 0.00 0.00 -1.02 0.00 0.00 32.46 30.18 2wdh n ARG 126 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2wdh n LYS 127 N 0.01 1.00 -3.74 5.56 4.76 -1.25 -4.24 118.16 120.25 2wdh n LYS 127 Ca 0.04 0.00 -0.30 0.00 -2.87 0.00 0.00 58.31 55.19 2wdh n LYS 127 Cb 0.29 -1.29 -0.15 0.00 -1.84 0.00 0.00 35.03 32.04 2wdh n LYS 127 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2wdh s ALA 128 N -0.58 1.60 -0.89 7.82 0.00 -1.24 -5.23 121.76 123.23 2wdh s ALA 128 Ca 0.00 -1.73 0.07 0.00 0.00 0.00 0.00 51.96 50.30 2wdh s ALA 128 Cb 0.00 -1.64 0.06 0.00 0.00 0.00 0.00 23.12 21.53 2wdh s ALA 128 CO 0.00 -1.68 0.72 0.45 0.00 0.00 0.00 175.76 175.25